Vitas-M small molecule compound

7,7-dimethyl-10-(3-nitrophenyl)-6,7,8,10-tetrahydro[1,3]dioxolo[4,5-b]acridin-9(5H)-one

Catalog ID
STK334753
SMILES O=C1CC(C)(C)CC2=C1C(c1cccc(c1)[N+](=O)[O-])c1c(N2)cc2c(c1)OCO2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C22H20N2O5 MW 392.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O5/c1-22(2)9-16-21(17(25)10-22)20(12-4-3-5-13(6-12)24(26)27)14-7-18-19(29-11-28-18)8-15(14)23-16/h3-8,20,23H,9-11H2,1-2H3
InChIKey
TUOUDXQVNNBGSX-UHFFFAOYSA-N
Synonyms

77dimethyl10(3nitrophenyl)56810tetrahydro(13)benzodioxolo(56b)quinolin9one
77dimethyl10(3nitrophenyl)67810tetrahydro(13)dioxolo(45b)acridin9(5H)one
CC1(CC2=C(C(C3=CC4=C(C=C3N2)OCO4)C5=CC(=CC=C5)(N+)(=O)(O))C(=O)C1)C
InChI=1SC22H20N2O5c122(2)91621(17(25)1022)20(1243513(612)24(26)27)1471819(29112818)815(14)2316h382023H911H212H3
MFCD09963607
O=C1CC(C)(C)CC2=C1C(c1cccc(c1)(N+)(=O)(O))c1c(N2)cc2c(c1)OCO2
ZINC000018197433
ZINC000018197435

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Available files

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